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Ethyl 2-(4-nitrophenyl)butanoate is an organic compound with the chemical formula C12H15NO4. It is a derivative of butyric acid, featuring an ethyl ester group and a 4-nitrophenyl substituent. This yellow crystalline solid is soluble in organic solvents and has a molecular weight of 237.25 g/mol. It is synthesized by reacting 4-nitrophenyl butyrate with ethanol in the presence of a catalyst, such as sulfuric acid. Ethyl 2-(4-nitrophenyl)butanoate is used as an intermediate in the synthesis of various pharmaceuticals and agrochemicals, particularly in the production of certain herbicides and insecticides. Its chemical structure and properties make it a valuable building block in the development of new compounds with potential applications in various industries.

6973-78-0

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6973-78-0 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 6973-78-0 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 6,9,7 and 3 respectively; the second part has 2 digits, 7 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 6973-78:
(6*6)+(5*9)+(4*7)+(3*3)+(2*7)+(1*8)=140
140 % 10 = 0
So 6973-78-0 is a valid CAS Registry Number.
InChI:InChI=1/C12H15NO4/c1-3-11(12(14)17-4-2)9-5-7-10(8-6-9)13(15)16/h5-8,11H,3-4H2,1-2H3

6973-78-0SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name ethyl 2-(4-nitrophenyl)butanoate

1.2 Other means of identification

Product number -
Other names ethyl 2-(4'-nitrophenyl)butyrate

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:6973-78-0 SDS

6973-78-0Relevant academic research and scientific papers

Steroidal esters of the aromatic nitrogen mustard 2-[4-N,N-bis(2- chloroethyl)amino-phenyl]butanoic acid (2-PHE-BU): Synthesis and in-vivo biological evaluation

Papaconstantinou, Ioanna C.,Fousteris, Manolis A.,Koutsourea, Anna I.,Pairas, Georgios N.,Papageorgiou, Athanasios D.,Nikolaropoulos, Sotiris S.

, p. 52 - 65 (2013/02/25)

On the basis of the results of in-silico predictions and in an effort to extend our structure-activity relationship studies, the aromatic nitrogen mustard 2-[4-N,N-bis(2-chloroethyl) amino-phenyl]butanoic acid (2-PHE-BU) was synthesized and conjugated with various steroidal alcohols. The resulting steroidal esters were evaluated for their in-vivo toxicity and antileukemic activity in P388-leukemia-bearing mice. The new derivatives showed significantly reduced toxicity and marginally improved antileukemic activity compared with free 2-PHE-BU. Nevertheless, they did not prove to be superior either to the template steroidal ester used for in-silico predictions or to previously synthesized steroidal esters of aromatic nitrogen mustards. The results obtained indicate that in-silico design predictions may guide the design and synthesis of new bioactive steroidal esters, but further parameters should be considered aiming at the discovery of compounds with optimum activity.

The synthesis of (±)-aminoglutethimide via vicarious nucleophilic aromatic substitution of hydrogen

Bushell, Simon M.,Crump, J. Paul,Lawrence, Nicholas J.,Pineau, Guillaume

, p. 2269 - 2274 (2007/10/03)

The synthesis of aminoglutethimide via a one-pot coupling of nitrobenzene, ethyl 2-chlorobutyrate and 3-bromopropionitrile has been achieved via a process involving sequential vicarious nucleophilic aromatic substitution and alkylation.

Glutamine derivatives

-

, (2008/06/13)

Glutamine derivatives and non-toxic salts thereof have been found to have immunomodulating activities.

Tertiary aminoacids

-

, (2008/06/13)

New α-(cyclic tert. aminophenyl)-aliphatic acids, e.g. those of the formula STR1 and functional derivatives thereof, are anti-inflammatory agents.

Tertiary aminoacids

-

, (2008/06/13)

New α-(cyclic tert. aminophenyl)-aliphatic acids, e.g. those of the formula STR1 AND FUNCTIONAL DERIVATIVES THEREOF, ARE ANTI-INFLAMMATORY AGENTS.

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